0 mol 25 unq 0 iso 0 dist 8.40051 13.591 9.48085 8.6396 10.9391 9.49421 8.78181 6.08585 6.53269 5.77929 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 8.40051 13.591 9.48085 8.6396 10.9391 9.49421 10.9235 9.15781 9.81524 6.68639 numMergedOcc 0
2 mol 25 unq 2 iso 0 dist 8.6396 13.591 9.49421 8.40051 10.9391 9.48085 8.78181 5.77929 6.53269 6.08585 numMergedOcc 0
3 mol 25 unq 3 iso 0 dist 8.6396 13.591 9.49421 8.40051 10.9391 9.48085 10.9235 6.68639 9.81524 9.15781 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 6.36193 4.99692 9.22598 4.88613 4.81926 8.96727 5.84625 9.95364 9.01564 5.49591 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 4.88613 4.99692 8.96727 6.36193 4.81926 9.22598 5.84625 5.49591 9.01564 9.95364 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 6.18305 5.65986 7.4369 11.0671 5.4148 9.73086 9.54477 6.56633 6.14542 5.11416 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 8.58841 16.3337 9.85905 17.86 10.2879 6.72869 14.8689 6.45686 7.46095 4.85247 numMergedOcc 0
8 mol 112 unq 0 iso 0 dist 5.17585 3.82552 4.22363 10.5503 6.34999 7.7988 9.32042 4.35926 8.06134 6.41459 numMergedOcc 0
9 mol 112 unq 1 iso 0 dist 5.17585 3.82552 4.22363 10.5503 6.34999 7.7988 8.23777 5.76098 5.36587 7.64054 numMergedOcc 0
10 mol 112 unq 2 iso 0 dist 5.17585 3.82552 4.22363 10.5069 6.72751 9.40824 9.32042 4.35926 8.06134 7.18484 numMergedOcc 0
11 mol 112 unq 3 iso 0 dist 5.17585 3.82552 4.22363 10.5069 6.72751 9.40824 8.23777 5.76098 5.36587 10.9474 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 6.18763 5.92411 8.95212 8.44385 10.9871 6.99446 9.34823 5.13589 8.67537 10.8661 numMergedOcc 0
13 mol 119 unq 1 iso 0 dist 6.18763 5.92411 8.95212 5.63005 9.93257 7.64052 9.34823 5.13589 8.67537 12.0175 numMergedOcc 0
14 mol 119 unq 2 iso 0 dist 8.44385 5.92411 6.99446 6.18763 10.9871 8.95212 9.34823 10.8661 8.67537 5.13589 numMergedOcc 0
15 mol 119 unq 3 iso 0 dist 8.44385 5.92411 6.99446 5.63005 4.85907 7.64052 9.34823 10.8661 8.67537 12.0175 numMergedOcc 0
16 mol 119 unq 4 iso 0 dist 5.63005 5.92411 7.64052 6.18763 9.93257 8.95212 9.34823 12.0175 8.67537 5.13589 numMergedOcc 0
17 mol 119 unq 5 iso 0 dist 5.63005 5.92411 7.64052 8.44385 4.85907 6.99446 9.34823 12.0175 8.67537 10.8661 numMergedOcc 0
18 mol 134 unq 0 iso 0 dist 9.92932 3.76211 7.21868 13.0095 5.62899 9.66543 12.1527 4.57832 9.0176 7.1797 numMergedOcc 0
19 mol 134 unq 1 iso 0 dist 9.92932 3.76211 7.21868 9.60411 5.49782 7.93372 12.1527 4.57832 9.0176 5.29786 numMergedOcc 0
20 mol 134 unq 2 iso 0 dist 9.60411 3.76211 7.93372 13.0095 10.7144 9.66543 12.1527 5.29786 9.0176 7.1797 numMergedOcc 0
21 mol 134 unq 3 iso 0 dist 9.60411 3.76211 7.93372 9.92932 5.49782 7.21868 12.1527 5.29786 9.0176 4.57832 numMergedOcc 0
22 mol 134 unq 4 iso 0 dist 9.60369 4.63732 9.66543 9.55556 5.62899 7.21868 11.9876 7.1797 9.0176 4.57832 numMergedOcc 0
23 mol 134 unq 5 iso 0 dist 9.60369 4.63732 9.66543 12.1043 10.7144 7.93372 11.9876 7.1797 9.0176 5.29786 numMergedOcc 0
24 mol 134 unq 6 iso 0 dist 9.55556 4.63732 7.21868 9.60369 5.62899 9.66543 11.9876 4.57832 9.0176 7.1797 numMergedOcc 0
25 mol 134 unq 7 iso 0 dist 9.55556 4.63732 7.21868 12.1043 5.49782 7.93372 11.9876 4.57832 9.0176 5.29786 numMergedOcc 0
26 mol 181 unq 0 iso 0 dist 9.58911 17.3349 8.59874 9.86845 6.01247 9.76212 13.2834 6.06566 7.35884 4.43096 numMergedOcc 0
27 mol 181 unq 1 iso 0 dist 9.84952 9.77747 9.01624 13.0935 11.5866 5.05973 12.7332 7.20191 5.99437 5.48529 numMergedOcc 0
28 mol 181 unq 2 iso 0 dist 7.41378 4.76079 5.05973 10.8641 11.5866 9.01624 9.46838 5.48529 5.99437 7.20191 numMergedOcc 0
29 mol 229 unq 0 iso 0 dist 8.6537 3.72432 7.27993 8.75374 5.1556 9.51168 9.38362 6.65022 9.37336 5.42069 numMergedOcc 0
30 mol 229 unq 1 iso 0 dist 8.6537 3.72432 7.27993 5.57702 7.0298 6.95201 9.38362 6.65022 9.37336 10.2411 numMergedOcc 0
31 mol 229 unq 2 iso 0 dist 8.75374 3.72432 9.51168 8.6537 5.1556 7.27993 9.38362 5.42069 9.37336 6.65022 numMergedOcc 0
32 mol 229 unq 3 iso 0 dist 8.75374 3.72432 9.51168 5.57702 6.54885 6.95201 9.38362 5.42069 9.37336 10.2411 numMergedOcc 0
33 mol 229 unq 4 iso 0 dist 5.57702 3.72432 6.95201 8.6537 7.0298 7.27993 9.38362 10.2411 9.37336 6.65022 numMergedOcc 0
34 mol 229 unq 5 iso 0 dist 5.57702 3.72432 6.95201 8.75374 6.54885 9.51168 9.38362 10.2411 9.37336 5.42069 numMergedOcc 0
35 mol 234 unq 0 iso 0 dist 7.86368 9.8663 7.81215 11.8838 10.2693 5.64285 14.6064 10.0059 7.77911 5.08515 numMergedOcc 0
36 mol 267 unq 0 iso 0 dist 9.62043 8.3484 7.34981 14.5482 5.91646 8.8293 9.80577 8.37094 6.27154 9.14203 numMergedOcc 0
37 mol 277 unq 0 iso 0 dist 9.77689 17.8399 9.57499 17.2403 7.69449 5.46926 15.2129 6.28695 9.26157 4.37645 numMergedOcc 0
38 mol 277 unq 1 iso 0 dist 9.77689 17.8399 9.57499 19.3912 11.8268 8.9682 15.2129 6.28695 9.26157 7.70529 numMergedOcc 0
39 mol 277 unq 2 iso 0 dist 8.51931 6.17642 9.57499 8.96343 7.69449 5.46926 10.5 6.28695 9.26157 4.37645 numMergedOcc 0
40 mol 277 unq 3 iso 0 dist 8.51931 6.17642 9.57499 9.71491 11.8268 8.9682 10.5 6.28695 9.26157 7.70529 numMergedOcc 0
41 mol 277 unq 4 iso 0 dist 8.96343 6.17642 5.46926 8.51931 7.69449 9.57499 10.5 4.37645 9.26157 6.28695 numMergedOcc 0
42 mol 277 unq 5 iso 0 dist 8.96343 6.17642 5.46926 9.71491 7.08227 8.9682 10.5 4.37645 9.26157 7.70529 numMergedOcc 0
43 mol 277 unq 6 iso 0 dist 9.29635 12.2421 8.9682 17.8158 11.8268 9.57499 16.1262 7.70529 9.26157 6.28695 numMergedOcc 0
44 mol 277 unq 7 iso 0 dist 9.29635 12.2421 8.9682 14.3464 7.08227 5.46926 16.1262 7.70529 9.26157 4.37645 numMergedOcc 0
